N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-2-(5-chloranylquinolin-8-yl)oxy-N-methyl-ethanamide

Systemtic Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-2-(5-chloranylquinolin-8-yl)oxy-N-methyl-ethanamide Openeye Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-2-[(5-chloro-8-quinolyl)oxy]-N-methyl-acetamide CAS Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-2-[(5-chloro-8-quinolinyl)oxy]-N-methylacetamide IUPAC Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-2-(5-chloroquinolin-8-yl)oxy-N-methylacetamide Traditional Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-2-[(5-chloro-8-quinolyl)oxy]-N-methyl-acetamide Formula: C21H18ClN3O2S MolecularWeight: 411.90452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2S1)N(C)C(=O)COC3=C4C(=C(C=C3)Cl)C=CC=N4

Isomeric SMILES

C[C@H](C1=NC2=CC=CC=C2S1)N(C)C(=O)COC3=C4C(=C(C=C3)Cl)C=CC=N4

InChI

InChI=1S/C21H18ClN3O2S/c1-13(21-24-16-7-3-4-8-18(16)28-21)25(2)19(26)12-27-17-10-9-15(22)14-6-5-11-23-20(14)17/h3-11,13H,12H2,1-2H3/t13-/m1/s1